4-(2-methoxyethylsulfamoyl)-N-(4-propan-2-yloxyphenyl)benzamide

C19H24N2O5S — CID 109059796

IUPAC4-(2-methoxyethylsulfamoyl)-N-(4-propan-2-yloxyphenyl)benzamide
SMILESCOCCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(OC(C)C)cc2)cc1
InChIInChI=1S/C19H24N2O5S/c1-14(2)26-17-8-6-16(7-9-17)21-19(22)15-4-10-18(11-5-15)27(23,24)20-12-13-25-3/h4-11,14,20H,12-13H2,1-3H3,(H,21,22)
InChIKeyUGKRMXIQAHSLML-UHFFFAOYSA-N
MW392.48 g/mol
LogP2.65
Rot. Bonds9

About 4-(2-methoxyethylsulfamoyl)-N-(4-propan-2-yloxyphenyl)benzamide

4-(2-methoxyethylsulfamoyl)-N-(4-propan-2-yloxyphenyl)benzamide (PubChem CID 109059796) has the molecular formula C19H24N2O5S and a molecular weight of 392.48 g/mol. Its IUPAC name is 4-(2-methoxyethylsulfamoyl)-N-(4-propan-2-yloxyphenyl)benzamide.

Molecular Properties

Compound Name4-(2-methoxyethylsulfamoyl)-N-(4-propan-2-yloxyphenyl)benzamide
PubChem CID109059796
Molecular FormulaC19H24N2O5S
Molecular Weight392.48 g/mol
Exact Mass392.14
IUPAC Name4-(2-methoxyethylsulfamoyl)-N-(4-propan-2-yloxyphenyl)benzamide
SMILESCOCCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(OC(C)C)cc2)cc1
InChIInChI=1S/C19H24N2O5S/c1-14(2)26-17-8-6-16(7-9-17)21-19(22)15-4-10-18(11-5-15)27(23,24)20-12-13-25-3/h4-11,14,20H,12-13H2,1-3H3,(H,21,22)
InChIKeyUGKRMXIQAHSLML-UHFFFAOYSA-N
XLogP2.65
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.48
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(4-ethoxyphenyl)-4-(2-methoxyethylsulfamoyl)benzamide
CID 34677141
4-(2-methoxyethylsulfamoyl)-N-[4-(4-methylphenoxy)phenyl]benzamide
CID 24584227
4-propan-2-yloxy-N-[[4-(propylsulfamoyl)phenyl]carbamothioyl]benzamide
CID 4952269
N-(3-chloro-4-methylphenyl)-4-(2-methoxyethylsulfamoyl)benzamide
CID 17485467
N-(3-fluoro-4-methylphenyl)-4-(2-methoxyethylsulfamoyl)benzamide
CID 17455377
N-[4-(difluoromethoxy)phenyl]-4-(ethylsulfamoyl)benzamide
CID 9405047
4-(2-methoxyethoxy)-N-[4-(propan-2-ylsulfamoyl)phenyl]benzamide
CID 17353518
3-[(4-tert-butylphenyl)sulfonylamino]-N-(4-propan-2-yloxyphenyl)propanamide
CID 60516647
4-(2-methoxyethylsulfamoyl)-N-(3-methylphenyl)benzamide
CID 35437620
N-[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]-4-propan-2-yloxybenzamide
CID 4951888
4-(ethylsulfamoyl)-N-(4-methoxyphenyl)benzamide
CID 9411925
N-(4-methoxyphenyl)-2-[(4-propan-2-yloxyphenyl)sulfonylamino]acetamide
CID 112998764

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyethylsulfamoyl)-N-(4-propan-2-yloxyphenyl)benzamide?
The IUPAC name of 4-(2-methoxyethylsulfamoyl)-N-(4-propan-2-yloxyphenyl)benzamide (CID 109059796) is 4-(2-methoxyethylsulfamoyl)-N-(4-propan-2-yloxyphenyl)benzamide.
What is the SMILES notation for 4-(2-methoxyethylsulfamoyl)-N-(4-propan-2-yloxyphenyl)benzamide?
The canonical SMILES for 4-(2-methoxyethylsulfamoyl)-N-(4-propan-2-yloxyphenyl)benzamide is COCCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(OC(C)C)cc2)cc1.
What is the InChIKey of 4-(2-methoxyethylsulfamoyl)-N-(4-propan-2-yloxyphenyl)benzamide?
The InChIKey is UGKRMXIQAHSLML-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O5S/c1-14(2)26-17-8-6-16(7-9-17)21-19(22)15-4-10-18(11-5-15)27(23,24)20-12-13-25-3/h4-11,14,20H,12-13H2,1-3H3,(H,21,22).
What are the key properties of 4-(2-methoxyethylsulfamoyl)-N-(4-propan-2-yloxyphenyl)benzamide?
4-(2-methoxyethylsulfamoyl)-N-(4-propan-2-yloxyphenyl)benzamide has a molecular weight of 392.48 g/mol, XLogP of 2.65, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyethylsulfamoyl)-N-(4-propan-2-yloxyphenyl)benzamide is sourced from PubChem (CID 109059796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).